CID 3772977

2,4-dinitrophenylhydrazine

Structural Information

Molecular Formula

C₆H₆N₄O₄

SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN

InChI

InChI=1S/C6H6N4O4/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14/h1-3,8H,7H2

InChIKey

HORQAOAYAYGIBM-UHFFFAOYSA-N

Compound name

(2,4-dinitrophenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 792
References: 11666
Patents: 198.03891 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	199.04619	139.5
[M+Na]+	221.02813	150.8
[M+NH4]+	216.07273	146.3
[M+K]+	237.00207	165.6
[M-H]-	197.03163	144.1
[M+Na-2H]-	219.01358	144.6
[M]+	198.03836	141.9
[M]-	198.03946	141.9

Literature stripe

literature stripe

Patent stripe

patents stripe